Basic information
- Name:
Tanshinone IIA
- CAS No.:
568-72-9
- Molecular Structure:
- Formula:
- C19H18O3
- Molecular Weight:
- 294.33
- Synonyms:
- Phenanthro[1,2-b]furan-10,11-dione,6,7,8,9-tetrahydro-1,6,6-trimethyl-;TanshinoneIIA (7CI);1,6,6-Trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione;Dan Shenketone;NSC 686518;NSC 686519;Tanshinone B;Tanshinone II;
- Density:
- 1.209 g/cm3
- Melting Point:
- 205-207 °C
- Boiling Point:
- 480.7 °C at 760 mmHg
- Flash Point:
- 236.4 °C
- Solubility:
- Soluble in Alcohol and DMSO
- Appearance:
- Cherry crystal
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Chemistry
Molecular Formula: C14H10O3
Molar mass: 226.23 g/mol
Density: 1.209 g/cm3
Flash Point: 236.4 °C
Index of Refraction: 1.587
Boiling Point: 480.7 °C at 760 mmHg
Vapour Pressure: 2.12E-09 mmHg at 25 °C
Product categories of Tanshinone IIA (CAS NO.568-72-9): Plant Oils, Toxins, Phenolic Acids & Derivatives;Danshen
Structure of Tanshinone IIA (CAS NO.568-72-9):
XLogP3-AA: 4.3
H-Bond Donor: 0
H-Bond Acceptor: 3
IUPAC Name of Tanshinone IIA (CAS NO.568-72-9): 1,6,6-Trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione
Canonical SMILES: CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C
InChI: InChI=1S/C19H18O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,
2)3)15(12)17(21)16(20)14(10)18/h6-7,9H,4-5,8H2,1-3H3
InChIKey: HYXITZLLTYIPOF-UHFFFAOYSA-N
Specification
Tanshinone IIA , its cas register number is 568-72-9. It also can be called Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-1,6,6-trimethyl- and 1,6,6-Trimethyl-6,7,8,9-tetrahydrophenanthro[1,2-b]furan-10,11-dione .